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Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate
TL;DR: Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate (CAS 545347-85-1) is a chemical compound with molecular formula C17H18N2O4S and molecular weight 346.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate
Also Known As: ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate, ethyl 5-carbamoyl-4-methyl-2-[(phenylacetyl)amino]thiophene-3-carboxylate, ethyl 5-carbamoyl-4-methyl-2-(2-phenylacetylamino)thiophene-3-carboxylate, ethyl 5-(aminocarbonyl)-4-methyl-2-[(phenylacetyl)amino]-3-thiophenecarboxylate, ETHYL 5-CARBAMOYL-4-METHYL-2-(2-PHENYLACETAMIDO)THIOPHENE-3-CARBOXYLATE
| Molecular Formula | C17H18N2O4S |
|---|---|
| Molecular Weight | 346.10 g/mol |
| LogP | 2.51332 |
| Topological Polar Surface Area | 98.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 346.09872 |
| Heavy Atoms | 24 |
| Complexity | 768.39777 |
Chemical Identifiers
| CAS Number | 545347-85-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CC2=CC=CC=C2 |
Product Overview
Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate (CAS 545347-85-1), with molecular formula C17H18N2O4S and molecular weight 346.10 g/mol. IUPAC: ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate
Property Insights of Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate
The XLogP value of 2.51332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate. The TPSA of 98.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate?
The CAS number of Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate is 545347-85-1.
What is the molecular formula of Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate?
The molecular formula of Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate is C17H18N2O4S.
What is the molecular weight of Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate?
The molecular weight of Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate is 346.10 g/mol.
Where can I buy Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate?
You can request a quote for Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-carbamoyl-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.